{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.247505 0.2174365 0.42208 ] [ 0.0506875 0.0915851 2.362651 ] [ 1.429891 2.603248 1.463699 ] [ 0.6097234 2.164425 2.912732 ] [ 2.744149 0.6540612 0.6213704 ] [ 2.652131 2.68783 0.0915898 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.247505e-10 2.174365e-11 4.2208e-11 ] [ 5.068750000000001e-12 9.15851e-12 2.362651e-10 ] [ 1.429891e-10 2.603248e-10 1.463699e-10 ] [ 6.097234e-11 2.164425e-10 2.912732e-10 ] [ 2.744149e-10 6.540612e-11 6.213704e-11 ] [ 2.652131e-10 2.68783e-10 9.15898e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.5042175 -0.9864742 -0.4275421 ] [ 0.167441 -0.2164896 -0.2304167 ] [ -1.0199294 0.9810686 -0.2521445 ] [ -0.8929439 -0.3921696 2.2929703 ] [ 2.4068571 -1.5252362 0.9153179 ] [ 1.8427926 2.1393012 -2.298185 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.012198731898225e-09 -1.580505900262383e-09 -6.849979570277357e-10 ] [ 2.682700555633728e-10 -3.468545757663437e-10 -3.691682497818873e-10 ] [ -1.634107039546572e-09 1.571845174320987e-09 -4.039800229633056e-10 ] [ -1.430653840265973e-09 -6.283249645084878e-10 3.673743406848762e-09 ] [ 3.856210175226487e-09 -2.443697780837833e-09 1.466500939979752e-09 ] [ 2.952479220703246e-09 3.427538367489385e-09 -3.682098277273248e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.965287 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.077267971336217e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8785366 0.3759677 0.4988099 ] [ 0.3234025 0.0122729 2.6824874 ] [ 0.9030665 2.6661274 0.9259343 ] [ 0.3471312 2.2296521 3.0960283 ] [ 3.1290959 0.458597 0.1286439 ] [ 3.1528542 2.6759687 0.5422184 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.785366e-11 3.759677e-11 4.988099e-11 ] [ 3.234025e-11 1.22729e-12 2.6824874e-10 ] [ 9.030665e-11 2.6661274e-10 9.259343e-11 ] [ 3.471312e-11 2.2296521e-10 3.0960283e-10 ] [ 3.1290959e-10 4.58597e-11 1.286439e-11 ] [ 3.1528542e-10 2.6759687e-10 5.422184e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.43e-05 1.06e-05 3e-05 ] [ 6.4e-06 2.39e-05 -3.54e-05 ] [ -1.4e-05 -1.79e-05 8.4e-06 ] [ 5.7e-06 -9.2e-06 1.6e-06 ] [ 3.82e-05 -5.9e-06 9e-07 ] [ -2e-06 -1.5e-06 -5.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.495465809344e-14 1.698307218048e-14 4.8065298624e-14 ] [ 1.025393037312e-14 3.829202123712e-14 -5.671705237632e-14 ] [ -2.24304726912e-14 -2.867896151232001e-14 1.345828361472e-14 ] [ 9.13240673856e-15 -1.474002491136e-14 2.56348259328e-15 ] [ 6.120314691456e-14 -9.45284206272e-15 1.44195895872e-15 ] [ -3.2043532416e-15 -2.4032649312e-15 -8.8119714144e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.015325 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.886373253111376e-18 } }